ATOM 63
1 C1b C 16.3100 -20.5800
2 C5a C 17.5700 -19.8800
3 S2a S 18.7600 -20.5800
4 C1b C 19.9500 -19.8800
5 C1b C 21.2100 -20.5800
6 N1b N 22.4000 -19.8800
7 C5a C 23.5900 -20.5800
8 C1b C 24.8500 -19.8800
9 C1b C 26.0400 -20.5800
10 N1b N 27.2300 -19.8800
11 C5a C 28.4900 -20.5800
12 C1c C 29.6800 -19.8800
13 C1d C 30.8700 -20.5800
14 C1b C 32.0600 -19.8800
15 O2b O 33.3200 -20.5800
16 O5a O 17.5700 -18.4800
17 O5a O 23.5900 -21.9800
18 O5a O 28.4900 -21.9800
19 O1a O 29.6800 -18.4800
20 C1a C 30.8700 -19.1800
21 C1a C 30.8700 -21.9800
22 P1b P 34.7200 -20.5800
23 O1c O 36.1200 -20.5800
24 O1c O 34.7200 -21.9800
25 C1y C 28.2100 -15.6100
26 C1y C 29.6100 -15.6100
27 C1y C 30.0300 -14.2800
28 O2x O 28.9100 -13.4400
29 C1y C 27.7900 -14.2800
30 C1b C 31.3600 -13.8600
31 O1a O 27.3700 -16.7300
32 O2b O 30.4500 -16.7300
33 P1b P 31.8500 -16.7300
34 O1c O 31.8500 -15.3300
35 O1c O 33.2500 -16.7300
36 O1c O 31.8500 -18.1300
37 C8y C 23.6600 -12.4600
38 C8y C 23.6600 -13.8600
39 N4y N 26.1100 -13.8600
40 C8x C 26.1100 -12.4600
41 N5x N 24.8500 -11.7600
42 C8y C 22.4700 -11.7600
43 N5x N 21.2100 -12.4600
44 C8x C 21.2100 -13.8600
45 N5x N 22.4700 -14.5600
46 N1a N 22.4700 -10.3600
47 O2b O 33.3200 -14.2800
48 P1b P 34.7200 -14.2800
49 O1c O 34.7200 -12.8800
50 O1c O 36.1200 -14.2800
51 O2c O 34.7200 -17.5000
52 C1b C 15.1200 -19.8800
53 C1b C 13.8600 -20.5800
54 C1b C 12.6000 -19.8800
55 C1b C 11.4100 -20.5100
56 C1b C 10.2200 -19.8100
57 C1b C 8.9600 -20.5100
58 C1b C 7.7700 -19.8100
59 C1b C 6.5800 -20.5100
60 C2b C 5.3900 -19.8100
61 C2b C 4.1300 -20.4400
62 C1b C 2.9400 -19.7400
63 C1a C 1.7500 -20.4400
BOND 65
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 2 16 2
16 7 17 2
17 11 18 2
18 12 19 1 #Down
19 13 20 1
20 13 21 1
21 15 22 1
22 22 23 2
23 22 24 1
24 25 26 1
25 26 27 1
26 27 28 1
27 28 29 1
28 25 29 1
29 27 30 1 #Down
30 25 31 1 #Up
31 26 32 1 #Up
32 32 33 1
33 33 34 1
34 33 35 1
35 33 36 2
36 37 38 2
37 38 39 1
38 39 40 1
39 40 41 2
40 37 41 1
41 37 42 1
42 42 43 2
43 43 44 1
44 44 45 2
45 38 45 1
46 42 46 1
47 29 39 1 #Down
48 30 47 1
49 47 48 1
50 48 49 1
51 48 50 2
52 48 51 1
53 22 51 1
54 1 52 1
55 52 53 1
56 53 54 1
57 54 55 1
58 55 56 1
59 56 57 1
60 57 58 1
61 58 59 1
62 59 60 1
63 60 61 2
64 61 62 1
65 62 63 1
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